orbital_charges     :real:2:9,9
  0.130032249873263E+001  0.995611235841659E+000  0.990544507814679E+000
  0.859199471156204E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.194135020181206E+001  0.197167580373894E+001  0.194133081487668E+001
  0.123755424369516E+001  0.852345083664723E-002  0.734411276927896E-003
  0.627773030543570E-002  0.116854868263145E-001  0.197204267073040E-001
  0.926903166331083E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.924409493180986E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.926866984725071E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.174309330271198E+001  0.136658665548253E+001  0.150968479435157E+001
  0.166106638564750E+001  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.120643733292041E+001  0.777049171886329E+000  0.830417255128020E+000
  0.885854508886376E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.980669652805279E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.976431012322228E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,9
  0.249347025910174E-005  0.163026563398568E-004  0.248428810605238E-004
  0.246956438150134E-005  0.676423060289640E-005  0.112725332114590E-004
 -0.109721890931835E-004 -0.959361953986604E-005 -0.251821805875938E-004
  0.173957211550141E-004  0.255837241953938E-006  0.763815443310945E-006
 -0.979359565982801E-005 -0.188850716456718E-004 -0.188726395930899E-004
  0.134898713106124E-004  0.898170274332699E-005  0.128947525986911E-004
  0.667267524333548E-004 -0.390654745194563E-004 -0.582750524182329E-004
 -0.531197136893480E-004  0.514336488303306E-005  0.725618567423789E-005
 -0.286898810973255E-004  0.300963738939369E-004  0.452997046107573E-004
mermin_energy       :real:0:
 -0.115846440613475E+002
end_coords          :real:2:3,9
 -0.878907162010066E-001 -0.118310761559492E+000 -0.184588003609303E+000
  0.346378486893589E+001  0.464635090069609E+000  0.733879286458303E+000
 -0.523323744842406E+000 -0.213113367837435E+001 -0.245069816429170E+000
 -0.136333894572768E+001  0.755257120102155E+000  0.117685856816654E+001
 -0.519274991281246E+000  0.669948280676320E+000 -0.203857189060239E+001
  0.895321615705684E+001  0.144942267130416E+001  0.228263216342849E+001
  0.103742233255502E+002  0.484243348790826E+000  0.824077729173927E+000
  0.124910141775780E+002  0.605747297026349E+000  0.102773192064245E+001
  0.971970482003369E+001 -0.623677917645087E+000 -0.870121247742851E+000
